AB00117952-01
TL;DR: AB00117952-01 (CAS 432018-93-4) is a chemical compound with molecular formula C23H21BrN4O2 and molecular weight 464.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-[(4-bromophenyl)methyl]-5-[[2,5-dimethyl-1-(4-methyl-2-pyridinyl)pyrrol-3-yl]methylidene]imidazolidine-2,4-dione
Also Known As: AB00117952-01, (5E)-3-[(4-bromophenyl)methyl]-5-[[2,5-dimethyl-1-(4-methylpyridin-2-yl)pyrrol-3-yl]methylidene]imidazolidine-2,4-dione, (5E)-3-(4-bromobenzyl)-5-{[2,5-dimethyl-1-(4-methylpyridin-2-yl)-1H-pyrrol-3-yl]methylidene}imidazolidine-2,4-dione, (5E)-3-[(4-BROMOPHENYL)METHYL]-5-{[2,5-DIMETHYL-1-(4-METHYLPYRIDIN-2-YL)-1H-PYRROL-3-YL]METHYLIDENE}IMIDAZOLIDINE-2,4-DIONE
| Molecular Formula | C23H21BrN4O2 |
|---|---|
| Molecular Weight | 464.08 g/mol |
| LogP | 4.65296 |
| Topological Polar Surface Area | 67.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 464.08478 |
| Heavy Atoms | 30 |
| Complexity | 1178.4138 |
Chemical Identifiers
| CAS Number | 432018-93-4 |
|---|---|
| SMILES | CC1=CC(=NC=C1)N2C(=CC(=C2C)/C=C/3\C(=O)N(C(=O)N3)CC4=CC=C(C=C4)Br)C |
Product Overview
AB00117952-01 (CAS 432018-93-4), with molecular formula C23H21BrN4O2 and molecular weight 464.08 g/mol. IUPAC: (5E)-3-[(4-bromophenyl)methyl]-5-[[2,5-dimethyl-1-(4-methyl-2-pyridinyl)pyrrol-3-yl]methylidene]imidazolidine-2,4-dione.
Chemical Property Profile of AB00117952-01
Property Insights of AB00117952-01
The XLogP value of 4.65296 indicates that AB00117952-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.23 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00117952-01. Following Lipinski's Rule of Five, AB00117952-01 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00117952-01?
The CAS number of AB00117952-01 is 432018-93-4.
What is the molecular formula of AB00117952-01?
The molecular formula of AB00117952-01 is C23H21BrN4O2.
What is the molecular weight of AB00117952-01?
The molecular weight of AB00117952-01 is 464.08 g/mol.
Where can I buy AB00117952-01?
You can request a quote for AB00117952-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117952-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117952-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.